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7,2'-dihydroxy-4',5'-methylenedioxyisoflavan

PropertiesImage
MNX_IDMNXM147872 Image of MNXM147872
referencemetacycM:CPD-17502
formulaC16H14O5
global charge0
mol weight286.283
InChIKeyCSVCGRYSLOYOMZ-JTQLQIEISA-N
InChIInChI=1S/C16H14O5/c17-11-2-1-9-3-10(7-19-14(9)4-11)12-5-15-16(6-13(12)18)21-8-20-15/h1-2,4-6,10,17-18H,3,7-8H2/t10-/m0/s1
SMILESOC1=CC=C2C[C@H](C3=C(O)C=C4OCOC4=C3)COC2=C1
MNX internals
InChI (mnx)InChI=1/C16H14O5/c17-11-2-1-9-3-10(7-19-14(9)4-11)12-5-15-16(6-13(12)18)21-8-20-15/h1-2,4-6,10,17-18H,3,7-8H2/t10-/m0/s1 Image of MNXM147872
SMILES (mnx)[CH:1]1=[CH:2][C:11]([OH:17])=[CH:4][C:14]2=[C:9]1[CH2:3][C@H:10]([C:12]1=[CH:5][C:15]3=[C:16]([CH:6]=[C:13]1[OH:18])[O:21][CH2:8][O:20]3)[CH2:7][O:19]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-17502
metacycM:CPD-17502
seed.compound:cpd34113
seedM:cpd34113
CSVCGRYSLOYOMZ-JTQLQIEISA-N
7,2'-dihydroxy-4',5'-methylenedioxyisoflavan

seedM:M_cpd34113
secondary/obsolete/fantasy identifier